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(3,3-difluoro-1-methylcyclobutyl)methanol - 97%, high purity , CAS No.1408076-35-6

COA

Grade & Purity:

≥97%

Cas Number: 1408076-35-6
Molecular Weight: 136.142
PubChem CID: 58564885

In stock

Item Number

D174024

Grouped product items
SKU	Size	Availability	Price	Qty
D174024-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$3,036.90

Basic Description

Synonyms	(3,3-difluoro-1-methylcyclobutyl)methanol \| 1408076-35-6 \| (3,3-Difluoro-1-methyl-cyclobutyl)methanol \| Cyclobutanemethanol, 3,3-difluoro-1-methyl- \| MFCD23106031 \| SCHEMBL15085828 \| AKOS025290332 \| PB37739 \| SB20744 \| AS-34714 \| SY241105 \| 3,3-Difluoro-1-methylcyclobutane-1-m
Specifications & Purity	≥97%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Alcohols and polyols

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Alcohols and polyols
Intermediate Tree Nodes	Not available
Direct Parent	Primary alcohols
Alternative Parents	Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework	Aliphatic homomonocyclic compounds
Substituents	Hydrocarbon derivative - Primary alcohol - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aliphatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as primary alcohols. These are compounds comprising the primary alcohol functional group, with the general structure RCOH (R=alkyl, aryl).
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	(3,3-difluoro-1-methylcyclobutyl)methanol
INCHI	InChI=1S/C6H10F2O/c1-5(4-9)2-6(7,8)3-5/h9H,2-4H2,1H3
InChIKey	CJAWZBDZCFSXMU-UHFFFAOYSA-N
Smiles	CC1(CC(C1)(F)F)CO
Isomeric SMILES	CC1(CC(C1)(F)F)CO
Molecular Weight	136.142
Reaxy-Rn	29167665
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=29167665&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	136.140 g/mol
XLogP3	1.400
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	136.07 Da
Monoisotopic Mass	136.07 Da
Topological Polar Surface Area	20.200 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	114.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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